(2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoyl]-4-phenyl-butan-2-yl]propanamide

Systemtic Name: (2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoyl]-4-phenyl-butan-2-yl]propanamide Openeye Name: (2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoylmethyl]-3-phenyl-propyl]propanamide CAS Name: (2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoyl]-4-phenylbutan-2-yl]propanamide IUPAC Name: (2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoyl]-4-phenylbutan-2-yl]propanamide Traditional Name: (2S)-2-acetamido-3-cyclohexyl-N-[1-[(4-methoxyphenyl)sulfamoylmethyl]-3-phenyl-propyl]propionamide Formula: C28H39N3O5S MolecularWeight: 529.69136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1CCCCC1)C(=O)NC(CCC2=CC=CC=C2)CS(=O)(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1CCCCC1)C(=O)NC(CCC2=CC=CC=C2)CS(=O)(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C28H39N3O5S/c1-21(32)29-27(19-23-11-7-4-8-12-23)28(33)30-25(14-13-22-9-5-3-6-10-22)20-37(34,35)31-24-15-17-26(36-2)18-16-24/h3,5-6,9-10,15-18,23,25,27,31H,4,7-8,11-14,19-20H2,1-2H3,(H,29,32)(H,30,33)/t25?,27-/m0/s1